Geometry & MOs

Info

ID:	201352
PubChem CID:	79527390
Reduced:	ON2C17H26 (1)
Stoich.:	AB2C17D26 (1)
Weight, g/mol:	200.152478
ΔH_f, kcal/mol:	-59.46
Dipole, Da:	2.55
IP(EA), eV:	-8.65(0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(aminomethyl)-N-(2-hydroxyethyl)cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC=C1)NC(=O)C2CCC(CC2)CN

DOS

IR

Vibrations