Geometry & MOs

Info

ID:	280454
PubChem CID:	103849378
Reduced:	N3O4C13H17 (1)
Stoich.:	A3B4C13D17 (1)
Weight, g/mol:	283.214744
ΔH_f, kcal/mol:	-158.53
Dipole, Da:	3.36
IP(EA), eV:	-9.22(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-tert-butyl-N-[(3-hydroxyoxolan-3-yl)methyl]cyclohexane-1-carboxamide

Drug info:

PubChemData

Smile

C1COCC1(CNC(=O)C2=CC=C(C=C2)NC(=O)N)O

DOS

IR

Vibrations