Geometry & MOs

Info

ID:	271036
PubChem CID:	103641027
Reduced:	SN3C16H19 (1)
Stoich.:	AB3C16D19 (1)
Weight, g/mol:	280.157563
ΔH_f, kcal/mol:	74.08
Dipole, Da:	2.33
IP(EA), eV:	-8.52(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-indol-7-ylmethyl)-2-(3-methoxyphenyl)ethanamine

Drug info:

PubChemData

Smile

CCC1=CC=C(S1)CNCC2=NN(C3=CC=CC=C32)C

DOS

IR

Vibrations