Geometry & MOs

Info

ID:	75929
PubChem CID:	48424176
Reduced:	NOC11H13 (2)
Stoich.:	ABC11D13 (2)
Weight, g/mol:	381.168856
ΔH_f, kcal/mol:	-30.61
Dipole, Da:	2.05
IP(EA), eV:	-8.35(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[3-(3-cyanopropoxy)anilino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=CC=C1CN2CCC3=CC=CC=C32)OCC4CC4

DOS

IR

Vibrations