Geometry & MOs

Info

ID:	186145
PubChem CID:	77396104
Reduced:	O4C11H14 (1)
Stoich.:	A4B11C14 (1)
Weight, g/mol:	259.189592
ΔH_f, kcal/mol:	-144.15
Dipole, Da:	4.75
IP(EA), eV:	-8.58(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(methoxymethyl)-5-(3,5,5-triamino-4-methylpent-3-en-2-yl)oxolan-3-ol

Drug info:

PubChemData

Smile

CC1CC(=C(C=C1C2(CC2)C(=O)O)O)O

DOS

IR

Vibrations