Geometry & MOs

Info

ID:	339319
PubChem CID:	127261153
Reduced:	OC14H18 (1)
Stoich.:	AB14C18 (1)
Weight, g/mol:	225.147727
ΔH_f, kcal/mol:	-34.11
Dipole, Da:	2.64
IP(EA), eV:	-8.67(0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-hydroxyethyl-[2-[[(Z)-pyrrol-2-ylidenemethyl]amino]ethyl]amino]ethanol

Drug info:

PubChemData

Smile

C/C(=C/1\CCCCC1C2=CC=CC=C2)/O

DOS

IR

Vibrations