Geometry & MOs

Info

ID:	293629
PubChem CID:	117394638
Reduced:	N4C15H20 (1)
Stoich.:	A4B15C20 (1)
Weight, g/mol:	256.168797
ΔH_f, kcal/mol:	76.14
Dipole, Da:	0.71
IP(EA), eV:	-9.22(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-4-[4-(pyrrolidin-1-ylmethyl)phenyl]pyrazol-3-amine

Drug info:

PubChemData

Smile

C1CCC(CC1)(CN)C2=CC=CC=C2N3N=CC=N3

DOS

IR

Vibrations