Geometry & MOs

Info

ID:	233920
PubChem CID:	92192453
Reduced:	FNSO4C19H30 (1)
Stoich.:	ABCD4E19F30 (1)
Weight, g/mol:	427.153206
ΔH_f, kcal/mol:	-231.04
Dipole, Da:	4.38
IP(EA), eV:	-9.68(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E)-N-benzyl-2-[(3-methoxybenzoyl)hydrazinylidene]chromene-3-carboxamide

Drug info:

PubChemData

Smile

CC[C@@H](C)[C@@H](C(=O)OCC)N(CCC(C)C)S(=O)(=O)C1=CC=C(C=C1)F

DOS

IR

Vibrations