Geometry & MOs

Info

ID:	247992
PubChem CID:	103078000
Reduced:	N2C8H11 (2)
Stoich.:	A2B8C11 (2)
Weight, g/mol:	239.17461
ΔH_f, kcal/mol:	53.75
Dipole, Da:	2.42
IP(EA), eV:	-7.95(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methyl-3-N-(3-morpholin-4-ylpropyl)pyrazole-3,4-diamine

Drug info:

PubChemData

Smile

CN1C=C(C(=N1)N2CCC(CC2)CC3=CC=CC=C3)N

DOS

IR

Vibrations