Geometry & MOs

Info

ID:	306734
PubChem CID:	125236542
Reduced:	O2N3C22H25 (1)
Stoich.:	A2B3C22D25 (1)
Weight, g/mol:	344.209993
ΔH_f, kcal/mol:	-44.25
Dipole, Da:	6.83
IP(EA), eV:	-8.52(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-[(4S)-1'-ethylspiro[3,4-dihydrochromene-2,4'-piperidine]-4-yl]oxolane-2-carboxamide

Drug info:

PubChemData

Smile

CC(=O)N1C[C@@H]2[C@H](C1)C3=CC=CC=C3[C@H]2NC(=O)C4=CC(=CC=C4)N(C)C

DOS

IR

Vibrations