Geometry & MOs

Info

ID:	222598
PubChem CID:	85305592
Reduced:	SiO4C21H32 (1)
Stoich.:	AB4C21D32 (1)
Weight, g/mol:	377.133065
ΔH_f, kcal/mol:	-160.14
Dipole, Da:	1.55
IP(EA), eV:	-8.73(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-(1,3-dithian-2-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-5-oxopentanoate

Drug info:

PubChemData

Smile

CC(C)(C)[Si]1(OCC2C(O1)C=CC(O2)OCC3=CC=CC=C3)C(C)(C)C

DOS

IR

Vibrations