Geometry & MOs

Info

ID:	272766
PubChem CID:	103756096
Reduced:	ON3C16H21 (1)
Stoich.:	AB3C16D21 (1)
Weight, g/mol:	400.91975
ΔH_f, kcal/mol:	-21.14
Dipole, Da:	4.2
IP(EA), eV:	-9.42(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dibromopyrazin-2-yl)-2-(4-methoxyphenyl)acetamide

Drug info:

PubChemData

Smile

CC1(CCCCC1)CNC(=O)C2=CC3=C(C=C2)N=CN3

DOS

IR

Vibrations