Geometry & MOs

Info

ID:	142534
PubChem CID:	53051541
Reduced:	ON5C20H23 (1)
Stoich.:	AB5C20D23 (1)
Weight, g/mol:	346.179361
ΔH_f, kcal/mol:	52.23
Dipole, Da:	6.25
IP(EA), eV:	-8.77(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1-cyclopentylbenzotriazol-5-yl)-(3,4-dihydro-2H-quinolin-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N(N=N4)C

DOS

IR

Vibrations