Geometry & MOs

Info

ID:	190027
PubChem CID:	77943441
Reduced:	FNC26H30 (1)
Stoich.:	ABC26D30 (1)
Weight, g/mol:	341.21435
ΔH_f, kcal/mol:	-10.53
Dipole, Da:	3.35
IP(EA), eV:	-8.31(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-3-(3,3-dimethylbut-1-enyl)-4-(4-methylphenyl)quinoline

Drug info:

PubChemData

Smile

CC1=C(N(C(=C1C2=CC=CC=C2)C3=CC=C(C=C3)F)C=CC(C)(C)C)C(C)C

DOS

IR

Vibrations