Geometry & MOs

Info

ID:	129853
PubChem CID:	51074061
Reduced:	N3O3C15H17 (1)
Stoich.:	A3B3C15D17 (1)
Weight, g/mol:	324.147393
ΔH_f, kcal/mol:	-80.84
Dipole, Da:	1.27
IP(EA), eV:	-9.05(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[[(E)-3-[5-(2-methylcyclopropyl)furan-2-yl]prop-2-enoyl]amino]methyl]benzamide

Drug info:

PubChemData

Smile

CN1C(=O)CCC(=N1)C(=O)NC2CCOC3=CC=CC=C23

DOS

IR

Vibrations