Geometry & MOs

Info

ID:	424347
PubChem CID:	135122318
Reduced:	FSN2H5C8 (1)
Stoich.:	ABC2D5E8 (1)
Weight, g/mol:	336.12224
ΔH_f, kcal/mol:	27.25
Dipole, Da:	2.67
IP(EA), eV:	-9.44(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-(5-pyridin-3-yl-1H-indole-2-carbonyl)azetidin-3-yl]carbamic acid

Drug info:

PubChemData

Smile

C1=CN=C(N=C1)C2=CC=C(S2)F

DOS

IR

Vibrations