Geometry & MOs

Info

ID:	29399
PubChem CID:	833522
Reduced:	O2N3C15H15 (1)
Stoich.:	A2B3C15D15 (1)
Weight, g/mol:	248.098334
ΔH_f, kcal/mol:	-2.18
Dipole, Da:	5.9
IP(EA), eV:	-9.24(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[benzyl(methyl)carbamothioyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1)C(=O)C2=CC=C(C=C2)NC(=O)C3CC3

DOS

IR

Vibrations