Geometry & MOs

Info

ID:	182588
PubChem CID:	76910822
Reduced:	N2O3C16H20 (1)
Stoich.:	A2B3C16D20 (1)
Weight, g/mol:	297.241627
ΔH_f, kcal/mol:	-71.09
Dipole, Da:	11.94
IP(EA), eV:	-8.9(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-amino-3-hydroxyimino-2-methylpropyl)-4-butyl-N-methylcyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

CC(CN(C)CC1=C(C=CC(=C1)C=CC(=O)O)OC)C#N

DOS

IR

Vibrations