Geometry & MOs

Info

ID:	430270
PubChem CID:	135170334
Reduced:	O2N3C19H21 (1)
Stoich.:	A2B3C19D21 (1)
Weight, g/mol:	401.283098
ΔH_f, kcal/mol:	0.53
Dipole, Da:	1.33
IP(EA), eV:	-8.18(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-cyclohepta-1,6-dien-1-yl-8-ethyl-2,2-dimethyl-7-(pyrrolidin-1-ylmethyl)-1,3-dihydropyrrolo[3,2-c]quinoline

Drug info:

PubChemData

Smile

CC1=NC2=C(C=C1)C(=NC3=CC(=C(C=C32)OC)ON4CCCC4)C

DOS

IR

Vibrations