Geometry & MOs

Info

ID:	276103
PubChem CID:	103820593
Reduced:	N2O2C17H24 (1)
Stoich.:	A2B2C17D24 (1)
Weight, g/mol:	269.137556
ΔH_f, kcal/mol:	-88.84
Dipole, Da:	4.12
IP(EA), eV:	-8.85(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(2-hydroxyethyl)pentyl]-5-nitro-1H-pyrrole-2-carboxamide

Drug info:

PubChemData

Smile

CCCC(CCO)CNC(=O)C1=C(NC2=CC=CC=C21)C

DOS

IR

Vibrations