Geometry & MOs

Info

ID:	221957
PubChem CID:	85292973
Reduced:	SiN2O4C21H40 (1)
Stoich.:	AB2C4D21E40 (1)
Weight, g/mol:	413.220223
ΔH_f, kcal/mol:	-213.23
Dipole, Da:	1.14
IP(EA), eV:	-8.78(0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-hydroxy-4-phenyl-2-(2,10,10-trimethyl-4-oxo-3-oxa-6-azatricyclo[7.1.1.02,7]undec-6-en-5-yl)butanoate

Drug info:

PubChemData

Smile

CCOC(=O)C1(CCN(CC(=C[Si](C)(C)C(C)(C)C)C1)N(C)C)C(=O)OCC

DOS

IR

Vibrations