Geometry & MOs

Info

ID:	88839
PubChem CID:	49957220
Reduced:	N2O3C25H32 (1)
Stoich.:	A2B3C25D32 (1)
Weight, g/mol:	371.130363
ΔH_f, kcal/mol:	-109.37
Dipole, Da:	4.38
IP(EA), eV:	-8.89(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(3-butan-2-yloxybenzoyl)carbamothioylamino]benzamide

Drug info:

PubChemData

Smile

CCCCCCCOC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)C(=O)N3CCCC3

DOS

IR

Vibrations