Geometry & MOs

Info

ID:	255854
PubChem CID:	103135210
Reduced:	N4C15H22 (1)
Stoich.:	A4B15C22 (1)
Weight, g/mol:	264.114174
ΔH_f, kcal/mol:	54.52
Dipole, Da:	5.61
IP(EA), eV:	-8.93(0.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3-chloropyridin-4-yl)-(1-methylpyrazol-3-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCNC(CCC1=CN=CC=C1)C2=NN(C=C2)C

DOS

IR

Vibrations