Geometry & MOs

Info

ID:	270837
PubChem CID:	103638372
Reduced:	N3C17H21 (1)
Stoich.:	A3B17C21 (1)
Weight, g/mol:	280.193949
ΔH_f, kcal/mol:	59.82
Dipole, Da:	0.5
IP(EA), eV:	-9.16(-1.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[cyclohepten-1-yl(quinolin-6-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CNC(C1=CCCCCC1)C2=CC3=NC=CN=C3C=C2

DOS

IR

Vibrations