Geometry & MOs

Info

ID:	367280
PubChem CID:	127324057
Reduced:	ON3C10H13 (2)
Stoich.:	AB3C10D13 (2)
Weight, g/mol:	342.205576
ΔH_f, kcal/mol:	-53.6
Dipole, Da:	4.55
IP(EA), eV:	-8.95(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-cyclopropylpyrrolidin-3-yl)-3-[1-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]urea

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)NC(C)C3=CC4=C(C=C3)NC(=O)CC4

DOS

IR

Vibrations