Geometry & MOs

Info

ID:	272653
PubChem CID:	103750755
Reduced:	N2O3C15H20 (1)
Stoich.:	A2B3C15D20 (1)
Weight, g/mol:	293.173942
ΔH_f, kcal/mol:	-95.1
Dipole, Da:	5.15
IP(EA), eV:	-9.79(-0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(carbamoylamino)methyl]-N-(1-hydroxy-4-methylpentan-3-yl)benzamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NC(=O)COC1=CC=CC=C1C#N

DOS

IR

Vibrations