Geometry & MOs

Info

ID:	208816
PubChem CID:	80588618
Reduced:	ON2C16H24 (1)
Stoich.:	AB2C16D24 (1)
Weight, g/mol:	391.90166
ΔH_f, kcal/mol:	-45.61
Dipole, Da:	3.44
IP(EA), eV:	-8.64(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-carbamothioyl-N-(2,4-dibromophenyl)cyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

CC1CC(C1)(CN)C(=O)NC2=CC=C(C=C2)C(C)C

DOS

IR

Vibrations