Geometry & MOs

Info

ID:	284269
PubChem CID:	104039138
Reduced:	N5C15H27 (1)
Stoich.:	A5B15C27 (1)
Weight, g/mol:	189.101445
ΔH_f, kcal/mol:	13.71
Dipole, Da:	4.41
IP(EA), eV:	-8.39(0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-N-(1H-pyrazol-5-ylmethyl)pyridine-2,4-diamine

Drug info:

PubChemData

Smile

CC(C)C(CNC1=CC(=NC=C1)N)N2CCN(CC2)C

DOS

IR

Vibrations