Geometry & MOs

Info

ID:	411538
PubChem CID:	135084370
Reduced:	OSiC16H28 (1)
Stoich.:	ABC16D28 (1)
Weight, g/mol:	202.135765
ΔH_f, kcal/mol:	-75.17
Dipole, Da:	1.64
IP(EA), eV:	-8.75(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hept-3-ynoxymethylbenzene

Drug info:

PubChemData

Smile

CC(C)(C)[Si](C)(C)OCCC1=C(CCCC1)C#C

DOS

IR

Vibrations