Geometry & MOs

Info

ID:	135405
PubChem CID:	51867511
Reduced:	N3O4C23H33 (1)
Stoich.:	A3B4C23D33 (1)
Weight, g/mol:	451.174336
ΔH_f, kcal/mol:	-183.98
Dipole, Da:	3.46
IP(EA), eV:	-9.01(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

butyl 4-[[2-[(4S)-2',5'-dioxospiro[2,3-dihydrochromene-4,4'-imidazolidine]-1'-yl]acetyl]amino]benzoate

Drug info:

PubChemData

Smile

CC(C)CCN(CCC(C)C)C(=O)CN1C(=O)[C@]2(CCOC3=CC=CC=C32)NC1=O

DOS

IR

Vibrations