Geometry & MOs

Info

ID:	344511
PubChem CID:	127268095
Reduced:	O2N4C23H32 (1)
Stoich.:	A2B4C23D32 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-70.1
Dipole, Da:	3.17
IP(EA), eV:	-8.88(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-(1H-indole-2-carbonyl)piperazin-1-yl]-N-(2-methylcyclohexyl)acetamide

Drug info:

PubChemData

Smile

CC(C(=O)NCC1CCCCC1)N2CCN(CC2)C(=O)C3=CC4=CC=CC=C4N3

DOS

IR

Vibrations