Geometry & MOs

Info

ID:	220829
PubChem CID:	85240144
Reduced:	O3C17H24 (1)
Stoich.:	A3B17C24 (1)
Weight, g/mol:	276.118171
ΔH_f, kcal/mol:	-113.07
Dipole, Da:	2.29
IP(EA), eV:	-9.46(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

benzyl 4-trimethylsilyloxypent-2-ynoate

Drug info:

PubChemData

Smile

CC1(C2CC1C(C(C2)O)(COCC3=CC=CC=C3)O)C

DOS

IR

Vibrations