Geometry & MOs

Info

ID:	296166
PubChem CID:	117558626
Reduced:	SN2O2C10H20 (1)
Stoich.:	AB2C2D10E20 (1)
Weight, g/mol:	232.193949
ΔH_f, kcal/mol:	-107.67
Dipole, Da:	5.96
IP(EA), eV:	-9.39(0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(4-propan-2-ylphenyl)cyclohexane-1,2-diamine

Drug info:

PubChemData

Smile

C1CCC(C(C1)N)NC2CCS(=O)(=O)C2

DOS

IR

Vibrations