Geometry & MOs

Info

ID:	330018
PubChem CID:	127247005
Reduced:	O2N4C19H26 (1)
Stoich.:	A2B4C19D26 (1)
Weight, g/mol:	328.189926
ΔH_f, kcal/mol:	-31.95
Dipole, Da:	5.07
IP(EA), eV:	-8.7(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[3-[[2-[6-(methylamino)pyrazin-2-yl]pyrrolidin-1-yl]methyl]phenoxy]ethanol

Drug info:

PubChemData

Smile

CCOC1=C(C=C(C=C1)CN2CCCC2C3=CN=CC(=N3)NC)CO

DOS

IR

Vibrations