Geometry & MOs

Info

ID:	284851
PubChem CID:	104077290
Reduced:	SN2O2C14H16 (1)
Stoich.:	AB2C2D14E16 (1)
Weight, g/mol:	240.093249
ΔH_f, kcal/mol:	-27.21
Dipole, Da:	1.99
IP(EA), eV:	-9.33(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 2-(cyclopropylmethylamino)-2-(1,3-thiazol-2-yl)acetate

Drug info:

PubChemData

Smile

CCOC(=O)C(C1=NC=CS1)NCC2=CC=CC=C2

DOS

IR

Vibrations