Geometry & MOs

Info

ID:	404184
PubChem CID:	135065369
Reduced:	NO5C14H17 (1)
Stoich.:	AB5C14D17 (1)
Weight, g/mol:	313.0717
ΔH_f, kcal/mol:	-201.24
Dipole, Da:	3.01
IP(EA), eV:	-9.62(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-acetamido-2-acetyloxy-3-(4-chlorophenyl)propanoate

Drug info:

PubChemData

Smile

CC(=O)NC(C1=CC=CC=C1)C(C(=O)OC)OC(=O)C

DOS

IR

Vibrations