Geometry & MOs

Info

ID:	381091
PubChem CID:	134971729
Reduced:	N2O5C17H20 (1)
Stoich.:	A2B5C17D20 (1)
Weight, g/mol:	220.128572
ΔH_f, kcal/mol:	-163.95
Dipole, Da:	2.66
IP(EA), eV:	-9.32(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl-methylidene-[(Z,2R)-2-phenylhex-3-en-3-yl]-lambda4-sulfane

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1[C@H](C(=O)/C(=C\NO)/C1=O)CC2=CC=CC=C2

DOS

IR

Vibrations