Geometry & MOs

Info

ID:	219642
PubChem CID:	85164230
Reduced:	NSiS2O8C22H33 (1)
Stoich.:	ABC2D8E22F33 (1)
Weight, g/mol:	531.31373
ΔH_f, kcal/mol:	-264.83
Dipole, Da:	5.15
IP(EA), eV:	-9.29(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[1,2-diphenyl-3-(1,2,3,4-tetrahydronaphthalen-2-ylmethoxy)but-1-enyl]phenoxy]-N,N-dimethylethanamine

Drug info:

PubChemData

Smile

CC1C2(C(C(C(O1)OCC3=CC=CC=C3[N+](=O)[O-])OCOCC[Si](C)(C)C)OC(=S)S2)CCO

DOS

IR

Vibrations