Geometry & MOs

Info

ID:	398125
PubChem CID:	135031881
Reduced:	SiO2C9H14 (1)
Stoich.:	AB2C9D14 (1)
Weight, g/mol:	412.109293
ΔH_f, kcal/mol:	-108.6
Dipole, Da:	1.65
IP(EA), eV:	-8.83(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(E)-4-(furan-2-yl)-1-(4-nitrophenyl)but-3-en-2-yl]-4-methylbenzenesulfonamide

Drug info:

PubChemData

Smile

C[Si](C)(C)C1=C(C=CC=C1O)O

DOS

IR

Vibrations