Geometry & MOs

Info

ID:	147480
PubChem CID:	53787136
Reduced:	O3H16C20 (1)
Stoich.:	A3B16C20 (1)
Weight, g/mol:	201.093583
ΔH_f, kcal/mol:	-35.41
Dipole, Da:	4.81
IP(EA), eV:	-8.24(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N'-[(2-ethylcyclopropyl)carbamoyl]carbamimidothioate

Drug info:

PubChemData

Smile

C1C=CC2=CC=C3C4C5C(O5)C(C(C4=CC6=C3C2=C1C=C6)O)O

DOS

IR

Vibrations