Geometry & MOs

Info

ID:	167101
PubChem CID:	74779767
Reduced:	SN3O6H15C18 (1)
Stoich.:	AB3C6D15E18 (1)
Weight, g/mol:	375.08735
ΔH_f, kcal/mol:	-58.01
Dipole, Da:	4.4
IP(EA), eV:	-9.42(-1.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methoxy-2-oxoethyl) 3-[(2-chlorobenzoyl)amino]-3-phenylpropanoate

Drug info:

PubChemData

Smile

CC(C(=O)OCC1=NOC(=C1)C2=CC=CS2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

DOS

IR

Vibrations