Geometry & MOs

Info

ID:	268467
PubChem CID:	103599516
Reduced:	O3N4C23H30 (1)
Stoich.:	A3B4C23D30 (1)
Weight, g/mol:	414.144038
ΔH_f, kcal/mol:	-59.38
Dipole, Da:	3.1
IP(EA), eV:	-8.36(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(furan-2-yl)-3-[3-(5-methyltetrazol-1-yl)anilino]-3-oxoprop-1-en-2-yl]benzamide

Drug info:

PubChemData

Smile

CCN1CCN(CC1)CCCNC(=O)C(=CC2=CC=CO2)NC(=O)C3=CC=CC=C3

DOS

IR

Vibrations