Geometry & MOs

Info

ID:	206182
PubChem CID:	80217982
Reduced:	SO2N3C15H25 (1)
Stoich.:	AB2C3D15E25 (1)
Weight, g/mol:	289.251798
ΔH_f, kcal/mol:	-79.05
Dipole, Da:	7.1
IP(EA), eV:	-9.15(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1(CCC(CC1)N(C)S(=O)(=O)C2=CN=C(C=C2)NC)C

DOS

IR

Vibrations