Geometry & MOs

Info

ID:	406500
PubChem CID:	135077821
Reduced:	NSSiO2C28H37 (1)
Stoich.:	ABCD2E28F37 (1)
Weight, g/mol:	214.135765
ΔH_f, kcal/mol:	10.71
Dipole, Da:	4.93
IP(EA), eV:	-8.46(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(Z)-3-ethynyl-1-phenylhept-2-en-1-ol

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C1=CC=CC=C1)(C2=CC=CC=C2)OCC[C@H](C#C)N(CC#C)[S@](=O)C(C)(C)C

DOS

IR

Vibrations