Geometry & MOs

Info

ID:	192144
PubChem CID:	78233511
Reduced:	O2N3C22H23 (1)
Stoich.:	A2B3C22D23 (1)
Weight, g/mol:	389.187005
ΔH_f, kcal/mol:	7.63
Dipole, Da:	7.97
IP(EA), eV:	-8.28(-1.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-chlorophenyl)-1-cyclopropyl-1-[(6-methyl-2-oxo-3,4,4a,5,6,7,8,8a-octahydro-1H-quinolin-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)N(CC2C=C3C=C(C=CC3=NC2=O)C)C4CC4

DOS

IR

Vibrations