Geometry & MOs

Info

ID:	258618
PubChem CID:	103155647
Reduced:	N2O2C13H26 (1)
Stoich.:	A2B2C13D26 (1)
Weight, g/mol:	257.119798
ΔH_f, kcal/mol:	-126.8
Dipole, Da:	3.98
IP(EA), eV:	-9.46(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(4-ethyl-5-methyl-1,3-thiazol-2-yl)-3-methoxybutanamide

Drug info:

PubChemData

Smile

CCC1CCC(CC1)NC(=O)CC(CN)OC

DOS

IR

Vibrations