Geometry & MOs

Info

ID:	375823
PubChem CID:	134221814
Reduced:	SN2O6C28H28 (1)
Stoich.:	AB2C6D28E28 (1)
Weight, g/mol:	387.180999
ΔH_f, kcal/mol:	-151.78
Dipole, Da:	7.43
IP(EA), eV:	-8.83(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NE)-N-[6-[(E)-4,4,4-trifluoro-3-(3,4,5-trimethylphenyl)but-1-enyl]-3,4-dihydro-2H-naphthalen-1-ylidene]hydroxylamine

Drug info:

PubChemData

Smile

CC/C(=C/C=C(/C(=O)COC1=CC=C(C=C1)C[C@]2(C(=O)NC(=O)S2)C(=O)OCC3=CC=CC=C3)\N=C)/C

DOS

IR

Vibrations