Geometry & MOs

Info

ID:	282059
PubChem CID:	103914989
Reduced:	ON5C12H17 (1)
Stoich.:	AB5C12D17 (1)
Weight, g/mol:	272.02727
ΔH_f, kcal/mol:	7.48
Dipole, Da:	3.7
IP(EA), eV:	-8.86(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(5-bromopyrimidin-4-yl)amino]pentanamide

Drug info:

PubChemData

Smile

CC1=C(N=NC(=C1C#N)NCCCCC(=O)N)C

DOS

IR

Vibrations