Geometry & MOs

Info

ID:	198449
PubChem CID:	79101610
Reduced:	ON2C13H22 (1)
Stoich.:	AB2C13D22 (1)
Weight, g/mol:	235.168462
ΔH_f, kcal/mol:	-43.27
Dipole, Da:	5.2
IP(EA), eV:	-8.73(1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-(1-aminoethyl)pyrrol-1-yl]-N-cyclopropyl-N-ethylacetamide

Drug info:

PubChemData

Smile

CC(C1=CN(C=C1)CCCN2CCCC2)O

DOS

IR

Vibrations