Geometry & MOs

Info

ID:	130205
PubChem CID:	51075253
Reduced:	O2N5H17C19 (1)
Stoich.:	A2B5C17D19 (1)
Weight, g/mol:	246.092376
ΔH_f, kcal/mol:	50.77
Dipole, Da:	6.08
IP(EA), eV:	-9.28(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-chlorophenyl)-N-methyl-N-(pyridin-2-ylmethyl)methanamine

Drug info:

PubChemData

Smile

CC(C(=O)NCC1=CN=C(C=C1)N2C=CC=N2)OC3=CC=C(C=C3)C#N

DOS

IR

Vibrations