Geometry & MOs

Info

ID:	351584
PubChem CID:	127280476
Reduced:	O3N5C21H27 (1)
Stoich.:	A3B5C21D27 (1)
Weight, g/mol:	370.200491
ΔH_f, kcal/mol:	-95.49
Dipole, Da:	4.82
IP(EA), eV:	-9.22(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-[4-(2-pyrrolidin-1-ylacetyl)piperazine-1-carbonyl]-3,4-dihydro-1H-quinolin-2-one

Drug info:

PubChemData

Smile

CC1=C2C(=CC=C1)C(=O)N(C=N2)CC(=O)N3CCN(CC3)C(=O)CN4CCCC4

DOS

IR

Vibrations