Geometry & MOs

Info

ID:	200881
PubChem CID:	79458055
Reduced:	NC8H13 (2)
Stoich.:	AB8C13 (2)
Weight, g/mol:	238.123676
ΔH_f, kcal/mol:	-19.61
Dipole, Da:	1.67
IP(EA), eV:	-8.07(0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(3-chloro-2-methylphenyl)cyclohexane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)NC2CCCC(C2)N

DOS

IR

Vibrations