Geometry & MOs

Info

ID:	222224
PubChem CID:	85295373
Reduced:	O4C13H20 (1)
Stoich.:	A4B13C20 (1)
Weight, g/mol:	240.050339
ΔH_f, kcal/mol:	-194.93
Dipole, Da:	5.31
IP(EA), eV:	-9.88(0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(5-methylpyrazin-2-yl)ethylideneamino]carbamodithioate

Drug info:

PubChemData

Smile

CC(=O)CCC1CCCC(C1=O)CCOC=O

DOS

IR

Vibrations