Geometry & MOs

Info

ID:	70141
PubChem CID:	47208115
Reduced:	N2O3C15H22 (1)
Stoich.:	A2B3C15D22 (1)
Weight, g/mol:	249.136493
ΔH_f, kcal/mol:	-134.94
Dipole, Da:	4.46
IP(EA), eV:	-10.1(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

hexyl 4-carbamoylbenzoate

Drug info:

PubChemData

Smile

CCCCCCOC(=O)C1=CC=C(C=C1)CNC(=O)N

DOS

IR

Vibrations