Geometry & MOs

Info

ID:	336323
PubChem CID:	127255330
Reduced:	O3N4C21H26 (1)
Stoich.:	A3B4C21D26 (1)
Weight, g/mol:	340.153541
ΔH_f, kcal/mol:	-91.02
Dipole, Da:	3.67
IP(EA), eV:	-8.44(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-methoxy-3-(5-methyl-1,3,4-oxadiazol-2-yl)phenyl]-4-pyrrol-1-ylbutanamide

Drug info:

PubChemData

Smile

C1CN(CC(=O)N1)C(=O)C2=CC(=CC=C2)NC(=O)CCCCCN3C=CC=C3

DOS

IR

Vibrations