Geometry & MOs

Info

ID:	365186
PubChem CID:	127317003
Reduced:	OSN6C18H26 (1)
Stoich.:	ABC6D18E26 (1)
Weight, g/mol:	353.221561
ΔH_f, kcal/mol:	12.47
Dipole, Da:	1.49
IP(EA), eV:	-8.84(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,3-dihydro-1H-inden-5-yl)-2-[4-[(1-methylimidazol-2-yl)methyl]piperazin-1-yl]acetamide

Drug info:

PubChemData

Smile

CN1C=CN=C1CN2CCN(CC2)CC(=O)NC3=NC4=C(S3)CCCC4

DOS

IR

Vibrations