Geometry & MOs

Info

ID:	198415
PubChem CID:	79098238
Reduced:	NC8H11 (2)
Stoich.:	AB8C11 (2)
Weight, g/mol:	229.157898
ΔH_f, kcal/mol:	27.05
Dipole, Da:	4.34
IP(EA), eV:	-8.56(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-1-[1-(pyridin-4-ylmethyl)pyrrol-3-yl]ethanamine

Drug info:

PubChemData

Smile

CCNC(C)C1=CN(C=C1)CC2=CC=CC=C2C

DOS

IR

Vibrations