Geometry & MOs

Info

ID:	261809
PubChem CID:	103252419
Reduced:	NO2C14H29 (1)
Stoich.:	AB2C14D29 (1)
Weight, g/mol:	256.124549
ΔH_f, kcal/mol:	-150.48
Dipole, Da:	0.7
IP(EA), eV:	-8.98(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(4-methylhexan-2-ylamino)methyl]-1,3-thiazole-2-carboxylic acid

Drug info:

PubChemData

Smile

CCC(C)CC(C)NCCC(=O)OC(C)(C)C

DOS

IR

Vibrations