Geometry & MOs

Info

ID:	438685
PubChem CID:	135228435
Reduced:	NO2C21H33 (1)
Stoich.:	AB2C21D33 (1)
Weight, g/mol:	359.246044
ΔH_f, kcal/mol:	-117.57
Dipole, Da:	4.01
IP(EA), eV:	-8.69(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[(5,5-dimethyl-2-propan-2-ylcyclohexanecarbonyl)amino]-1-phenylethyl] acetate

Drug info:

PubChemData

Smile

CC(C)C1CCC(CC1C(=O)NCCC2=CC=C(C=C2)OC)(C)C

DOS

IR

Vibrations