Geometry & MOs

Info

ID:	364787
PubChem CID:	127316125
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	361.19026
ΔH_f, kcal/mol:	-59.48
Dipole, Da:	4.76
IP(EA), eV:	-8.86(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydro-1H-cyclopenta[b]quinolin-9-yl-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]methanone

Drug info:

PubChemData

Smile

CC1C(OC2=CC=CC=C2O1)C(=O)N3CCN(CC3)CC4=NC=CN4

DOS

IR

Vibrations