Geometry & MOs

Info

ID:	75379
PubChem CID:	48423399
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-62.15
Dipole, Da:	2.72
IP(EA), eV:	-8.24(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(3-methylcyclohexyl)amino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(CNC(=O)C(C)OCC1CC1)N2CCC3=CC=CC=C32

DOS

IR

Vibrations