Geometry & MOs

Info

ID:	14311
PubChem CID:	408937
Reduced:	N5C8H9 (1)
Stoich.:	A5B8C9 (1)
Weight, g/mol:	175.085795
ΔH_f, kcal/mol:	118.29
Dipole, Da:	6.27
IP(EA), eV:	-9.62(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-prop-2-enyl-5H-purin-6-amine

Drug info:

PubChemData

Smile

C=CCNC1=NC=NC2=NC=NC21

DOS

IR

Vibrations