Geometry & MOs

Info

ID:	364827
PubChem CID:	127316235
Reduced:	O3N6C15H20 (1)
Stoich.:	A3B6C15D20 (1)
Weight, g/mol:	363.20591
ΔH_f, kcal/mol:	-81.31
Dipole, Da:	5.55
IP(EA), eV:	-9.34(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]-(6,7,8,9-tetrahydro-5H-carbazol-3-yl)methanone

Drug info:

PubChemData

Smile

CN1C(=O)C=CN(C1=O)CC(=O)N2CCN(CC2)CC3=NC=CN3

DOS

IR

Vibrations