Geometry & MOs

Info

ID:	53271
PubChem CID:	14709954
Reduced:	N2O7C16H22 (1)
Stoich.:	A2B7C16D22 (1)
Weight, g/mol:	225.100108
ΔH_f, kcal/mol:	-297.12
Dipole, Da:	4.22
IP(EA), eV:	-10.21(0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylpropyl 6-oxo-8-oxa-3-azatricyclo[3.2.1.02,4]octane-3-carboxylate

Drug info:

PubChemData

Smile

CC(=O)OC1C2CC(C(C2NC(=O)OC(C)(C)C)O1)(C#N)OC(=O)C

DOS

IR

Vibrations