Geometry & MOs

Info

ID:	252300
PubChem CID:	103110373
Reduced:	N2O2C15H16 (1)
Stoich.:	A2B2C15D16 (1)
Weight, g/mol:	271.135448
ΔH_f, kcal/mol:	-48.85
Dipole, Da:	4.71
IP(EA), eV:	-8.37(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-carbamothioyl-N-[1-[ethyl(methyl)amino]-1-oxopropan-2-yl]cyclobutane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC=C1N)CNC(=O)C2=CC=CC=C2O

DOS

IR

Vibrations