Geometry & MOs

Info

ID:	335670
PubChem CID:	127254532
Reduced:	O3N4C19H26 (1)
Stoich.:	A3B4C19D26 (1)
Weight, g/mol:	246.148061
ΔH_f, kcal/mol:	-107.12
Dipole, Da:	4.56
IP(EA), eV:	-8.87(0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1H-pyrazol-4-yl)-6-pyrrol-1-ylhexanamide

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C(=O)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3

DOS

IR

Vibrations