Geometry & MOs

Info

ID:	63909
PubChem CID:	26759460
Reduced:	NO5C21H25 (1)
Stoich.:	AB5C21D25 (1)
Weight, g/mol:	385.152537
ΔH_f, kcal/mol:	-176.94
Dipole, Da:	5.35
IP(EA), eV:	-8.47(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(2-acetylanilino)-1-oxopropan-2-yl] 2-(3,4-dimethoxyphenyl)acetate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)[C@H](C)OC(=O)CC2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations