Geometry & MOs

Info

ID:	341731
PubChem CID:	127264424
Reduced:	N3O3C21H25 (1)
Stoich.:	A3B3C21D25 (1)
Weight, g/mol:	381.205242
ΔH_f, kcal/mol:	-100.08
Dipole, Da:	5.35
IP(EA), eV:	-8.56(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-methoxyphenyl)-1-(2-methylpropyl)-1-[(2-oxo-3,4-dihydro-1H-quinolin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CCCN(CC1CC2=CC=CC=C2NC1=O)C(=O)NC3=CC(=CC=C3)OC

DOS

IR

Vibrations