Geometry & MOs

Info

ID:	435401
PubChem CID:	135191367
Reduced:	N3O5C25H39 (1)
Stoich.:	A3B5C25D39 (1)
Weight, g/mol:	415.104285
ΔH_f, kcal/mol:	-217.14
Dipole, Da:	6.34
IP(EA), eV:	-8.88(0.05)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2E,3E)-3-[[(E)-3-[3,4-bis(difluoromethoxy)phenyl]prop-2-enoyl]amino]-2-ethylidenehexa-3,5-dienoic acid

Drug info:

PubChemData

Smile

CCCC1(C(N(CCC1(CC(=O)NC(=O)N)C2=C(C=CC(=C2)OC)C(C)O)CC3CC3)C)O

DOS

IR

Vibrations