Geometry & MOs

Info

ID:	435734
PubChem CID:	135192271
Reduced:	O3C13H26 (1)
Stoich.:	A3B13C26 (1)
Weight, g/mol:	417.08004
ΔH_f, kcal/mol:	-183.32
Dipole, Da:	1.1
IP(EA), eV:	-9.65(2.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2R)-4-[4-[(6-bromo-2-methylimidazo[1,2-a]pyrazin-8-yl)amino]phenyl]morpholin-2-yl]methanol

Drug info:

PubChemData

Smile

CC(C)OCCC(C)(C)OC1CCCCO1

DOS

IR

Vibrations