Geometry & MOs

Info

ID:	371189
PubChem CID:	127344034
Reduced:	O2N3C18H27 (1)
Stoich.:	A2B3C18D27 (1)
Weight, g/mol:	361.284161
ΔH_f, kcal/mol:	-78.55
Dipole, Da:	1.67
IP(EA), eV:	-8.92(0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(1-ethylpyrazol-4-yl)-N-[2-(4-methylpiperidin-1-yl)propyl]piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)N2CCC(C2)NC(=O)NCC3(CCC3)O

DOS

IR

Vibrations