Geometry & MOs

Info

ID:	38382
PubChem CID:	8034342
Reduced:	SN3O4C18H23 (1)
Stoich.:	AB3C4D18E23 (1)
Weight, g/mol:	408.0797
ΔH_f, kcal/mol:	-140.33
Dipole, Da:	6.01
IP(EA), eV:	-8.64(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(3-bromophenyl)carbamoyl-(3-methylbutyl)amino]-N-(1,2-oxazol-3-yl)acetamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(N(C(=S)N[C@H]1C2=CC(=CC=C2)NC(=O)COC)C)C

DOS

IR

Vibrations