Geometry & MOs

Info

ID:

132476

PubChem CID:

51368077

Reduced:

N3O5H21C25 (1)

Stoich.:

A3B5C21D25 (1)

Weight, g/mol:

406.132885

ΔHf, kcal/mol:

-102.16

Dipole, Da:

7.57

IP(EA), eV:

-8.91(-1.48)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-(2-fluoro-5-methylphenyl)imino-N-(furan-2-ylmethyl)-8-methoxychromene-3-carboxamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=CC(=CC=C1)NC2=C(C=C3C=CC(=O)C=C3O2)C(=O)NC4=CC=CC(=N4)C

DOS

IR

Vibrations