Geometry & MOs

Info

ID:	58380
PubChem CID:	24698100
Reduced:	ClNOC4H4 (2)
Stoich.:	ABCD4E4 (2)
Weight, g/mol:	234.082684
ΔH_f, kcal/mol:	-28.05
Dipole, Da:	2.06
IP(EA), eV:	-9.24(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-carbamothioylphenyl)cyclobutanecarboxamide

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)Cl)Cl)OC/C(=N/O)/N

DOS

IR

Vibrations