Geometry & MOs

Info

ID:	320375
PubChem CID:	126659983
Reduced:	O2N3C21H27 (1)
Stoich.:	A2B3C21D27 (1)
Weight, g/mol:	382.10842
ΔH_f, kcal/mol:	-33.66
Dipole, Da:	2.59
IP(EA), eV:	-7.87(-0.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3E)-3-[[5-(3-chloro-2-methylphenyl)furan-2-yl]methylidene]-1,4-dimethyl-5-(methyliminomethyl)pyridine-2,6-dione

Drug info:

PubChemData

Smile

CCN(CC)C1=NC2=C(C=C(C=C2)NC(=O)/C=C/C(=C/C)/OC)C(=C1)C

DOS

IR

Vibrations