Geometry & MOs

Info

ID:	391375
PubChem CID:	135004576
Reduced:	NOSH19C21 (1)
Stoich.:	ABCD19E21 (1)
Weight, g/mol:	268.128388
ΔH_f, kcal/mol:	46.14
Dipole, Da:	3.36
IP(EA), eV:	-8.43(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2,2-diazido-5,5-dimethyl-3-oxohexanoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)N2C(=O)C[C@H]([C@H]3C2=CC=CC=C3)C4=CC=CS4

DOS

IR

Vibrations