Geometry & MOs

Info

ID:	299544
PubChem CID:	117687428
Reduced:	SN3O3C14H25 (1)
Stoich.:	AB3C3D14E25 (1)
Weight, g/mol:	301.146013
ΔH_f, kcal/mol:	-107.54
Dipole, Da:	4.27
IP(EA), eV:	-8.74(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(tert-butylsulfanylmethyl)-2-carbonazidoylhexanoate

Drug info:

PubChemData

Smile

CCOC(=O)C(CSC(C)(C)C)(C(=O)N=[N+]=[N-])C(C)(C)C

DOS

IR

Vibrations