Geometry & MOs

Info

ID:	171626
PubChem CID:	75408064
Reduced:	N2S2O3C13H18 (1)
Stoich.:	A2B2C3D13E18 (1)
Weight, g/mol:	337.236542
ΔH_f, kcal/mol:	-101.06
Dipole, Da:	4.19
IP(EA), eV:	-9.38(-1.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl-methylamino]cyclohexyl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)C1=NC=C(S1)/C=C/C(=O)N2CCCS2(=O)=O

DOS

IR

Vibrations