Geometry & MOs

Info

ID:	206183
PubChem CID:	80217983
Reduced:	N3C18H31 (1)
Stoich.:	A3B18C31 (1)
Weight, g/mol:	291.267448
ΔH_f, kcal/mol:	35.29
Dipole, Da:	5.19
IP(EA), eV:	-8.62(1.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-3-[(4,4-dimethylcyclohexyl)-methylamino]-2-(propylamino)propanenitrile

Drug info:

PubChemData

Smile

CC1(CCC(CC1)N(C)CC(C#N)(C2CC2)NC3CC3)C

DOS

IR

Vibrations