Geometry & MOs

Info

ID:	167422
PubChem CID:	74826543
Reduced:	ClSO2N3C23H24 (1)
Stoich.:	ABC2D3E23F24 (1)
Weight, g/mol:	317.12949
ΔH_f, kcal/mol:	-22.6
Dipole, Da:	3.79
IP(EA), eV:	-9.17(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(5-chloropyrazin-2-yl)ethyl]-2-(4-propan-2-ylphenyl)acetamide

Drug info:

PubChemData

Smile

CC(=O)N1C2CCC1CC(C2)NCC3=CC=C(C=C3)OC4=NC5=C(S4)C(=CC=C5)Cl

DOS

IR

Vibrations