Geometry & MOs

Info

ID:	258897
PubChem CID:	103157376
Reduced:	N2O2C17H26 (1)
Stoich.:	A2B2C17D26 (1)
Weight, g/mol:	287.093977
ΔH_f, kcal/mol:	-88.11
Dipole, Da:	5.15
IP(EA), eV:	-9.39(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[2-(2-aminoethyl)-1,3-thiazole-4-carbonyl]amino]-3-methoxybutanoic acid

Drug info:

PubChemData

Smile

C1CCC(C1)CC(CNCC(=O)NCC2=CC=CC=C2)O

DOS

IR

Vibrations