Geometry & MOs

Info

ID:	49090
PubChem CID:	11528699
Reduced:	O2C6H9 (2)
Stoich.:	A2B6C9 (2)
Weight, g/mol:	226.098728
ΔH_f, kcal/mol:	-147.47
Dipole, Da:	4.91
IP(EA), eV:	-9.96(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylcyclohexane-1,2-diamine;sulfuric acid

Drug info:

PubChemData

Smile

CC(C)(C)OC1(C=CC(=O)C=C1OC)OC

DOS

IR

Vibrations