Geometry & MOs

Info

ID:	441783
PubChem CID:	135244512
Reduced:	O5C33H44 (1)
Stoich.:	A5B33C44 (1)
Weight, g/mol:	380.105833
ΔH_f, kcal/mol:	-162.76
Dipole, Da:	6.2
IP(EA), eV:	-8.98(-1.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2,6-dichloro-3-[(2Z,4E)-3-hydroxy-5-methyl-4-(prop-2-enylideneamino)hepta-2,4-dien-2-yl]phenyl]-N-methylformamide

Drug info:

PubChemData

Smile

CCCCCC1=C(C(=C(C(=O)C1=O)C2C=C(CCC2C(=C)C)C)O)C(=O)OC3CC4CC45C3(CC5(C)C)C

DOS

IR

Vibrations