Geometry & MOs

Info

ID:	79338
PubChem CID:	49748142
Reduced:	BrN2S3O5C18H21 (1)
Stoich.:	AB2C3D5E18F21 (1)
Weight, g/mol:	379.156577
ΔH_f, kcal/mol:	-149.4
Dipole, Da:	3.34
IP(EA), eV:	-9.62(-1.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-(4-methylphenyl)sulfonyl-1-oxa-4,8-diazaspiro[4.5]decane-8-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)S(=O)(=O)N2CCOC23CCN(CC3)S(=O)(=O)C4=CC=C(S4)Br

DOS

IR

Vibrations