Geometry & MOs

Info

ID:	447696
PubChem CID:	135284858
Reduced:	FOSN2C18H19 (1)
Stoich.:	ABCD2E18F19 (1)
Weight, g/mol:	391.15299
ΔH_f, kcal/mol:	-39.7
Dipole, Da:	4.19
IP(EA), eV:	-8.23(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,6-difluorocarbazol-9-yl)-3-(5-ethyl-1,2,5-thiadiazinan-2-yl)propan-2-ol

Drug info:

PubChemData

Smile

C1CN(SC1F)CC(CN2C3=CC=CC=C3C4=CC=CC=C42)O

DOS

IR

Vibrations