Geometry & MOs

Info

ID:	188140
PubChem CID:	77672917
Reduced:	N3O5C20H23 (1)
Stoich.:	A3B5C20D23 (1)
Weight, g/mol:	581.226819
ΔH_f, kcal/mol:	-160.68
Dipole, Da:	7.55
IP(EA), eV:	-10.04(-1.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[3-[2-[[2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-1H-indol-7-yl]-(3,5-dimethylpiperidin-1-yl)methanone;2,2,2-trifluoroacetic acid

Drug info:

PubChemData

Smile

CC1CCCCC1NC(=O)NC(=O)COC(=O)C2=CC(=O)N=C3C2C=CC=C3

DOS

IR

Vibrations