Geometry & MOs

Info

ID:	225478
PubChem CID:	85852492
Reduced:	NO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	211.157229
ΔH_f, kcal/mol:	-70.6
Dipole, Da:	2.38
IP(EA), eV:	-10.81(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3,3-diethyl-2-isocyanopentanoate

Drug info:

PubChemData

Smile

CCC(C)(C)C(C(=O)OCC)[N+]#[C-]

DOS

IR

Vibrations