Geometry & MOs

Info

ID:	205490
PubChem CID:	80110675
Reduced:	N3O4C12H23 (1)
Stoich.:	A3B4C12D23 (1)
Weight, g/mol:	349.00958
ΔH_f, kcal/mol:	-207.9
Dipole, Da:	6.13
IP(EA), eV:	-9.76(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(5-bromo-1,3-thiazol-2-yl)carbamoylamino]methyl]-4-methylpentanoic acid

Drug info:

PubChemData

Smile

CCNC(=O)CNC(=O)NCC(CC(C)C)C(=O)O

DOS

IR

Vibrations