Geometry & MOs

Info

ID:	296613
PubChem CID:	117585772
Reduced:	N5C13H25 (1)
Stoich.:	A5B13C25 (1)
Weight, g/mol:	246.159295
ΔH_f, kcal/mol:	8.48
Dipole, Da:	2.6
IP(EA), eV:	-8.45(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-6-N-[2-(methylamino)ethyl]-4-N-(1H-pyrrol-3-yl)pyrimidine-4,6-diamine

Drug info:

PubChemData

Smile

CC1=NC(=CC(=N1)N(C)C(C)(C)C)N(C)CCN

DOS

IR

Vibrations