Geometry & MOs

Info

ID:	417220
PubChem CID:	135091731
Reduced:	ON6C21H30 (1)
Stoich.:	AB6C21D30 (1)
Weight, g/mol:	368.176979
ΔH_f, kcal/mol:	11.04
Dipole, Da:	3.34
IP(EA), eV:	-8.69(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-[(3S,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]benzamide

Drug info:

PubChemData

Smile

CC(C)C1=NN(C(=C1)C(=O)N2CCCC3(C2)CCC4=CN=C(N=C34)N(C)C)C

DOS

IR

Vibrations