Geometry & MOs

Info

ID:	36733
PubChem CID:	8012003
Reduced:	NO4C16H21 (1)
Stoich.:	AB4C16D21 (1)
Weight, g/mol:	414.179087
ΔH_f, kcal/mol:	-147.96
Dipole, Da:	5.84
IP(EA), eV:	-9.19(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[2-(2-methylpropylcarbamoyl)anilino]-2-oxoethyl] 3,4-dimethoxybenzoate

Drug info:

PubChemData

Smile

C1C[C@H](OC1)COC2=CC=C(C=C2)C(=O)N3CCOCC3

DOS

IR

Vibrations