Geometry & MOs

Info

ID:	34970
PubChem CID:	7979148
Reduced:	N3O5C21H21 (1)
Stoich.:	A3B5C21D21 (1)
Weight, g/mol:	345.121237
ΔH_f, kcal/mol:	-137.82
Dipole, Da:	4.02
IP(EA), eV:	-8.34(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,4-dimethoxyanilino)-2-oxoethyl] 3-methoxybenzoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C(=O)NNC(=O)[C@@H]2CC(=O)N(C2)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations