Geometry & MOs

Info

ID:	25367
PubChem CID:	623702
Reduced:	N2H18C19 (1)
Stoich.:	A2B18C19 (1)
Weight, g/mol:	274.10659
ΔH_f, kcal/mol:	88.2
Dipole, Da:	4.2
IP(EA), eV:	-8.15(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]pyrimidine-2,4-diamine

Drug info:

PubChemData

Smile

CN(C)C1=CC=C(C=C1)C=NC2=CC=CC3=CC=CC=C32

DOS

IR

Vibrations