Geometry & MOs

Info

ID:	263138
PubChem CID:	103341606
Reduced:	NC7H9 (2)
Stoich.:	AB7C9 (2)
Weight, g/mol:	228.162649
ΔH_f, kcal/mol:	32.1
Dipole, Da:	2.41
IP(EA), eV:	-8.56(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[2-(1H-pyrrol-2-yl)phenyl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNCC1=CC(=C(C=C1)C2=CC=CN2)C

DOS

IR

Vibrations