Geometry & MOs

Info

ID:	74946
PubChem CID:	48422739
Reduced:	NSO2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	388.163436
ΔH_f, kcal/mol:	-58.1
Dipole, Da:	2.92
IP(EA), eV:	-9.03(-0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-oxo-3-phenyl-1-(3,4,5-trimethoxyanilino)propan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC1C2=C(CCN1C(=O)C(C)OCC3CC3)SC=C2

DOS

IR

Vibrations