Geometry & MOs

Info

ID:	360407
PubChem CID:	127301052
Reduced:	O2N5C20H21 (1)
Stoich.:	A2B5C20D21 (1)
Weight, g/mol:	362.210661
ΔH_f, kcal/mol:	1.07
Dipole, Da:	5.86
IP(EA), eV:	-9.06(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-(4-methylpyrazol-1-yl)piperidin-1-yl]-(6,7,8,9-tetrahydro-5H-carbazol-1-yl)methanone

Drug info:

PubChemData

Smile

CC1=CN(N=C1)C2CCCN(C2)C(=O)C3=CC=C(NC3=O)C4=CC=CC=N4

DOS

IR

Vibrations