Geometry & MOs

Info

ID:	386741
PubChem CID:	134982752
Reduced:	NSO4C19H25 (1)
Stoich.:	ABC4D19E25 (1)
Weight, g/mol:	394.196421
ΔH_f, kcal/mol:	-149.62
Dipole, Da:	4.98
IP(EA), eV:	-8.94(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl (2E,4Z)-4-[[tert-butyl(diphenyl)silyl]oxymethyl]hexa-2,4-dienoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CC3=C(C(=C(CC3(C2)C)CO)CO)C

DOS

IR

Vibrations