Geometry & MOs

Info

ID:	240585
PubChem CID:	93616629
Reduced:	O2N3C15H23 (1)
Stoich.:	A2B3C15D23 (1)
Weight, g/mol:	277.179027
ΔH_f, kcal/mol:	-99.96
Dipole, Da:	6.03
IP(EA), eV:	-9.07(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[(2S)-heptan-2-yl]carbamoylamino]benzamide

Drug info:

PubChemData

Smile

CCCCC[C@@H](C)NC(=O)NC1=CC=C(C=C1)C(=O)N

DOS

IR

Vibrations