Geometry & MOs

Info

ID:	243107
PubChem CID:	99215689
Reduced:	N2O3C27H30 (1)
Stoich.:	A2B3C27D30 (1)
Weight, g/mol:	459.273321
ΔH_f, kcal/mol:	-79.65
Dipole, Da:	3.13
IP(EA), eV:	-8.64(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[4-[[2-[(1S)-6-methoxy-1,2,3,4-tetrahydronaphthalen-1-yl]acetyl]amino]butanoylamino]piperidine-1-carboxylate

Drug info:

PubChemData

Smile

C[C@H](C1=CC(=CC=C1)NC(=O)C2=CC=CC=C2)NC(=O)CCCCC3=CC=C(C=C3)OC

DOS

IR

Vibrations