Geometry & MOs

Info

ID:	433064
PubChem CID:	135173201
Reduced:	O2C10H15 (2)
Stoich.:	A2B10C15 (2)
Weight, g/mol:	379.200825
ΔH_f, kcal/mol:	-174.3
Dipole, Da:	1.92
IP(EA), eV:	-8.97(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[5-(3,4-dihydro-1H-[1,4]oxazino[4,3-a]benzimidazol-7-yl)pyrimidin-2-yl]piperidin-4-yl]ethanol

Drug info:

PubChemData

Smile

CCOC(=O)C(C(C)C12CC(C=C3CC(C1)C3C2)C)C(=O)OCC

DOS

IR

Vibrations