Geometry & MOs

Info

ID:	266562
PubChem CID:	103571699
Reduced:	NC4H6 (4)
Stoich.:	AB4C6 (4)
Weight, g/mol:	264.231397
ΔH_f, kcal/mol:	57.51
Dipole, Da:	3.78
IP(EA), eV:	-8.86(0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethylpiperidin-1-yl)-2-(1-propylpyrazol-4-yl)ethanamine

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)C(CN)N(C)CC2=CC=CC=C2

DOS

IR

Vibrations