Geometry & MOs

Info

ID:	130980
PubChem CID:	51138417
Reduced:	NOC5H5 (3)
Stoich.:	ABC5D5 (3)
Weight, g/mol:	369.157623
ΔH_f, kcal/mol:	-33.65
Dipole, Da:	8.16
IP(EA), eV:	-8.81(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(N-methylanilino)-4-[(3,4,5-trimethoxyphenyl)methyl]-2H-furan-5-one

Drug info:

PubChemData

Smile

CC1=C2C(CC(=O)N=C2N(N1)C)C3=CC4=C(C=C3)OCO4

DOS

IR

Vibrations