Geometry & MOs

Info

ID:	360403
PubChem CID:	127301048
Reduced:	O2N7C17H21 (1)
Stoich.:	A2B7C17D21 (1)
Weight, g/mol:	369.205242
ΔH_f, kcal/mol:	10.18
Dipole, Da:	6.01
IP(EA), eV:	-9.24(-0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-[3-(oxolan-2-ylmethoxy)phenyl]methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)CN3C=NC4=C(C3=O)C=NN4C

DOS

IR

Vibrations