Geometry & MOs

Info

ID:	187432
PubChem CID:	77571711
Reduced:	SN5O5C35H45 (1)
Stoich.:	AB5C5D35E45 (1)
Weight, g/mol:	338.081758
ΔH_f, kcal/mol:	-84.98
Dipole, Da:	7.87
IP(EA), eV:	-8.29(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN1CCC(C1)N(C)C(=O)C2CC=CC3=C4C(C4=CN5C(=CC6=C(C=CC(=C65)C7CCCCC7)OC)C23)C(=O)NS(=O)(=O)N(C)C

DOS

IR

Vibrations