Geometry & MOs

Info

ID:	444672
PubChem CID:	135263209
Reduced:	ClON2C16H19 (1)
Stoich.:	ABC2D16E19 (1)
Weight, g/mol:	495.252192
ΔH_f, kcal/mol:	-0.56
Dipole, Da:	2.48
IP(EA), eV:	-8.95(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-formyl-1H-indol-5-yl)-N-[(5-methylfuran-2-yl)-(4-methyl-2-piperidin-1-ylphenyl)methyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)C(C2=CC=C(O2)Cl)N)N3CCCC3

DOS

IR

Vibrations