Geometry & MOs

Info

ID:	388454
PubChem CID:	134989205
Reduced:	N3O3C7H13 (1)
Stoich.:	A3B3C7D13 (1)
Weight, g/mol:	270.165121
ΔH_f, kcal/mol:	-74.95
Dipole, Da:	4.72
IP(EA), eV:	-10.23(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl (4S)-4-[tert-butyl(dimethyl)silyl]oxyhex-2-ynoate

Drug info:

PubChemData

Smile

CCCC(C(C(=O)OC)N=[N+]=[N-])O

DOS

IR

Vibrations