Geometry & MOs

Info

ID:	372067
PubChem CID:	131292793
Reduced:	SN2O3C8H12 (1)
Stoich.:	AB2C3D8E12 (1)
Weight, g/mol:	211.110947
ΔH_f, kcal/mol:	-143.13
Dipole, Da:	7.21
IP(EA), eV:	-9.42(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-3-(2-methylquinolin-3-yl)propanenitrile

Drug info:

PubChemData

Smile

CCS(=C1C(=O)NC(=O)N(C1=O)C)C

DOS

IR

Vibrations