Geometry & MOs

Info

ID:	191029
PubChem CID:	78095839
Reduced:	INSiO4C22H26 (1)
Stoich.:	ABCD4E22F26 (1)
Weight, g/mol:	223.097521
ΔH_f, kcal/mol:	-93.8
Dipole, Da:	3.86
IP(EA), eV:	-8.45(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-amino-4,5-dimethyl-3-oxohexanoate;hydrochloride

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)CN=C2C3=CC(=C(C=C3C(=C([Si](C)(C)C)I)O2)OC)OC

DOS

IR

Vibrations