Geometry & MOs

Info

ID:	79418
PubChem CID:	49748520
Reduced:	FO2N3C20H22 (1)
Stoich.:	AB2C3D20E22 (1)
Weight, g/mol:	365.210327
ΔH_f, kcal/mol:	-100.17
Dipole, Da:	6.03
IP(EA), eV:	-8.19(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dimethylphenyl)-3-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-6-yl]urea

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCC2=C1C=CC(=C2)NC(=O)NC3=CC=CC=C3F

DOS

IR

Vibrations