Geometry & MOs

Info

ID:	416839
PubChem CID:	135090534
Reduced:	NOC12H15 (2)
Stoich.:	ABC12D15 (2)
Weight, g/mol:	361.112999
ΔH_f, kcal/mol:	-58.72
Dipole, Da:	4.09
IP(EA), eV:	-9.04(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-2-propyl-1,3-thiazole-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=CC(=CC=C2)C(=O)N3CC[C@]4(CCCN([C@@H]4C3)C)CO

DOS

IR

Vibrations