Geometry & MOs

Info

ID:	240920
PubChem CID:	93618203
Reduced:	O2N4C15H18 (1)
Stoich.:	A2B4C15D18 (1)
Weight, g/mol:	304.135782
ΔH_f, kcal/mol:	-19.18
Dipole, Da:	2.37
IP(EA), eV:	-8.4(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-ethyl-N-[(2R)-2-(N-methylanilino)propyl]thiadiazole-5-carboxamide

Drug info:

PubChemData

Smile

C[C@@H](CNC(=O)C1=NNC(=O)C=C1)N(C)C2=CC=CC=C2

DOS

IR

Vibrations