Geometry & MOs

Info

ID:	429601
PubChem CID:	135169650
Reduced:	ClOSF3N9H13C18 (1)
Stoich.:	ABCD3E9F13G18 (1)
Weight, g/mol:	288.12224
ΔH_f, kcal/mol:	-7.59
Dipole, Da:	7.45
IP(EA), eV:	-9.02(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-formamido-N-quinoxalin-5-ylcarbamate

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)SN)N)N2C(=C(C=N2)C(=O)NC3=CC(=C(N=C3)N4N=CC=N4)Cl)C(F)(F)F

DOS

IR

Vibrations