Geometry & MOs

Info

ID:	276916
PubChem CID:	103825760
Reduced:	N4C15H22 (1)
Stoich.:	A4B15C22 (1)
Weight, g/mol:	281.164046
ΔH_f, kcal/mol:	57.57
Dipole, Da:	3.79
IP(EA), eV:	-7.9(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-propan-2-ylpyrazol-4-yl)methyl]-2-pyrazol-1-ylaniline

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)CNC2=CC=CC=C2N(C)C

DOS

IR

Vibrations