Geometry & MOs

Info

ID:	401707
PubChem CID:	135052181
Reduced:	LiON2H7C8 (1)
Stoich.:	ABC2D7E8 (1)
Weight, g/mol:	308.119464
ΔH_f, kcal/mol:	-0.6
Dipole, Da:	7.52
IP(EA), eV:	-8.12(0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-(2,2-dimethylpropanoyl)-N'-(4-methoxybenzoyl)carbamimidothioate

Drug info:

PubChemData

Smile

[Li+].C1=CC=C2C(=C1)N=[C-]N2CO

DOS

IR

Vibrations