Geometry & MOs

Info

ID:	36150
PubChem CID:	7980822
Reduced:	N2O3H22C23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	418.152872
ΔH_f, kcal/mol:	-63.53
Dipole, Da:	2.18
IP(EA), eV:	-8.75(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-methyl-3-[[2-[2-(phenylcarbamoyl)phenoxy]acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)[C@H](C)OC2=CC=CC=C2C(=O)NC3=CC=CC=C3

DOS

IR

Vibrations