Geometry & MOs

Info

ID:	281000
PubChem CID:	103852361
Reduced:	O2F3N3C8H8 (1)
Stoich.:	A2B3C3D8E8 (1)
Weight, g/mol:	207.100777
ΔH_f, kcal/mol:	-193.03
Dipole, Da:	2.61
IP(EA), eV:	-10.58(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-hydroxy-3-methylpyrrolidin-1-yl)-pyridazin-4-ylmethanone

Drug info:

PubChemData

Smile

C1=CN=NC=C1C(=O)NCC(C(F)(F)F)O

DOS

IR

Vibrations