Geometry & MOs

Info

ID:	31290
PubChem CID:	855534
Reduced:	ClN2H17C18 (1)
Stoich.:	AB2C17D18 (1)
Weight, g/mol:	310.123676
ΔH_f, kcal/mol:	58.73
Dipole, Da:	3.27
IP(EA), eV:	-9.16(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-chloro-6,8-dimethylquinolin-3-yl)methyl]-1-phenylmethanamine

Drug info:

PubChemData

Smile

CC1=CC2=CC(=C(N=C2C=C1)Cl)CNCC3=CC=CC=C3

DOS

IR

Vibrations