Geometry & MOs

Info

ID:	390421
PubChem CID:	134999083
Reduced:	NSO3H19C21 (1)
Stoich.:	ABC3D19E21 (1)
Weight, g/mol:	336.098918
ΔH_f, kcal/mol:	-31.03
Dipole, Da:	4.1
IP(EA), eV:	-9.07(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[bis(2-methoxyethyl)amino]-5-chloro-6-(furan-2-yl)pyrazine-2-carbonitrile

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)/N=C(\C2=CC=CC=C2)/C3=CC=CC=C3OC

DOS

IR

Vibrations