Geometry & MOs

Info

ID:

210180

PubChem CID:

80770460

Reduced:

C7N8H10 (1)

Stoich.:

A7B8C10 (1)

Weight, g/mol:

256.168797

ΔHf, kcal/mol:

113.75

Dipole, Da:

6.08

IP(EA), eV:

-9.73(-0.86)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

6-N,2,5-trimethyl-4-N-(1-phenylethyl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CNC1=NC(=NC(=N1)N2C=NC=N2)NC

DOS

IR

Vibrations