Geometry & MOs

Info

ID:	335873
PubChem CID:	127254735
Reduced:	ON5C21H27 (1)
Stoich.:	AB5C21D27 (1)
Weight, g/mol:	271.168462
ΔH_f, kcal/mol:	30.25
Dipole, Da:	8.33
IP(EA), eV:	-8.58(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(pyridin-2-ylmethyl)-6-pyrrol-1-ylhexanamide

Drug info:

PubChemData

Smile

C1CN(CCC1C2=NN=C3N2C=CC=C3)C(=O)CCCCCN4C=CC=C4

DOS

IR

Vibrations