Geometry & MOs

Info

ID:	283084
PubChem CID:	103957126
Reduced:	NO2C16H21 (1)
Stoich.:	AB2C16D21 (1)
Weight, g/mol:	277.167794
ΔH_f, kcal/mol:	-42.62
Dipole, Da:	4.83
IP(EA), eV:	-9.14(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3,4-dihydroxy-N-[2-(3-methylcyclohexyl)ethyl]benzamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N(CC2CC2)CC3CC3)O

DOS

IR

Vibrations