Geometry & MOs

Info

ID:	179470
PubChem CID:	76486278
Reduced:	SSiN2O2C21H34 (1)
Stoich.:	ABC2D2E21F34 (1)
Weight, g/mol:	400.236208
ΔH_f, kcal/mol:	-113.86
Dipole, Da:	6.39
IP(EA), eV:	-8.59(-1.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-cyclohexyl-1-[5-oxo-4-(pyridin-4-ylmethylidene)oxolan-2-yl]ethyl]carbamate

Drug info:

PubChemData

Smile

CC1=C(N=CC=C1)CC(=S)C(C)C2C(C(=O)N2)C(C)O[Si](C)(C)C(C)(C)C

DOS

IR

Vibrations