Geometry & MOs

Info

ID:	180264
PubChem CID:	76605858
Reduced:	O3N5C25H33 (1)
Stoich.:	A3B5C25D33 (1)
Weight, g/mol:	584.357385
ΔH_f, kcal/mol:	-86.15
Dipole, Da:	2.93
IP(EA), eV:	-8.91(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-[cyclopropyl-[[1-(3-methoxypropyl)indol-3-yl]methyl]carbamoyl]-4-hydroxy-5-(2-methylpropylcarbamoyl)piperidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1CCCC(C1)C2=C(C3C(N2CC4=CC=CC=C4)C(=O)NCN3)C#N

DOS

IR

Vibrations