Geometry & MOs

Info

ID:	222512
PubChem CID:	85301111
Reduced:	NSSiO3C18H25 (1)
Stoich.:	ABCD3E18F25 (1)
Weight, g/mol:	368.104208
ΔH_f, kcal/mol:	-127.63
Dipole, Da:	4.89
IP(EA), eV:	-9.11(-0.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(2,3,3a,4-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzoxazin-7-yl)-2-oxo-1,3-oxazolidin-5-yl]methyl methanesulfonate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2C(CCC2=O)CC#CC[Si](C)(C)C

DOS

IR

Vibrations