Geometry & MOs

Info

ID:	11538
PubChem CID:	117372
Reduced:	NOC10H13 (2)
Stoich.:	ABC10D13 (2)
Weight, g/mol:	326.199428
ΔH_f, kcal/mol:	-41.26
Dipole, Da:	5.51
IP(EA), eV:	-8.09(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,4-dimethoxyphenyl)-N-(1,2,3,4-tetrahydroquinolin-2-ylmethyl)ethanamine

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCNCC2CCC3=CC=CC=C3N2)OC

DOS

IR

Vibrations