Geometry & MOs

Info

ID:	281605
PubChem CID:	103914106
Reduced:	NOC7H11 (2)
Stoich.:	ABC7D11 (2)
Weight, g/mol:	241.124883
ΔH_f, kcal/mol:	-81.28
Dipole, Da:	3.47
IP(EA), eV:	-8.86(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4,5-dimethyl-1,3-thiazol-2-yl)methylamino]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)N)NCCCOC1=CC=CC=C1

DOS

IR

Vibrations