Geometry & MOs

Info

ID:	429389
PubChem CID:	135169412
Reduced:	FSN2O2H7C8 (1)
Stoich.:	ABC2D2E7F8 (1)
Weight, g/mol:	218.123069
ΔH_f, kcal/mol:	-79.54
Dipole, Da:	3.37
IP(EA), eV:	-8.54(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2,2-difluoro-1-pyrrolidin-1-ylethenyl)morpholine

Drug info:

PubChemData

Smile

COC1=C2C(=C(C(=C1)O)F)SC(=N2)N

DOS

IR

Vibrations