Geometry & MOs

Info

ID:	351755
PubChem CID:	127282155
Reduced:	N3O4C21H29 (1)
Stoich.:	A3B4C21D29 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-152.62
Dipole, Da:	6.84
IP(EA), eV:	-8.91(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-2-[4-(2,3-dimethyl-1H-indole-5-carbonyl)piperazin-1-yl]propanamide

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)OCCO4

DOS

IR

Vibrations