Geometry & MOs

Info

ID:	74664
PubChem CID:	48422263
Reduced:	SN2O6C16H22 (1)
Stoich.:	AB2C6D16E22 (1)
Weight, g/mol:	354.124943
ΔH_f, kcal/mol:	-216.22
Dipole, Da:	6.9
IP(EA), eV:	-9.5(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[(1,1-dioxothiolan-3-yl)-methylamino]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NC1=CC=C(C=C1)S(=O)(=O)NCC(=O)OC)OCC2CC2

DOS

IR

Vibrations