Geometry & MOs

Info

ID:	424385
PubChem CID:	135122486
Reduced:	N4O5C27H36 (1)
Stoich.:	A4B5C27D36 (1)
Weight, g/mol:	306.194343
ΔH_f, kcal/mol:	-188.57
Dipole, Da:	3.63
IP(EA), eV:	-9.39(-1.25)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1-(3-hydroxy-2-methylpropyl)spiro[5,7-dihydroindazole-6,4'-oxane]-4-one

Drug info:

PubChemData

Smile

CCC1=NN(C2=C1C(=O)NCC3(C2)CCOCC3)CC(C)(C)COC(=O)C4=CC=C(C=C4)C(=O)NC

DOS

IR

Vibrations