Procorp is now available worldwide. Create Your Account today.
January 28, 2026
C7H11N
Datos Químicos de C7H11N
ID
17708
Molecular Scaffold
dfF@@@RftqBJjjjJHbrD`@
Molecular Formula
C7H11N
Elemental Composition %
C: 36.8421052631579%
H: 57.8947368421053%
O: 0%
N: 5.26315789473684%
Weight
109.171
Programa de Cálculo
G16
SMILES
C[C@H]1[C@H]2[C@@H]3N(C)[C@H]2[C@@H]13
Nivel de Teoría
B3LYP/6-31G(2df, p)
InChI
InChI=1S/C7H11N/c1-3-4-6-5(3)7(4)8(6)2/h3-7H,1-2H3
Calculation Keys
# B3LYP/6-31G(2df,p) scf=(maxcycle=9999) nosymm output=wfx
InChIKey
DFLKGKWHQIGVEE-UHFFFAOYSA-N