Geometry & MOs

Info

ID:	28102
PubChem CID:	825573
Reduced:	N3O4H17C18 (1)
Stoich.:	A3B4C17D18 (1)
Weight, g/mol:	320.116092
ΔH_f, kcal/mol:	3.19
Dipole, Da:	2.34
IP(EA), eV:	-9.48(-1.74)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[(3-methylbenzoyl)amino]phenyl]furan-2-carboxamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)C(=CC1=CC=C(O1)C2=CC(=CC=C2)[N+](=O)[O-])C#N

DOS

IR

Vibrations