Geometry & MOs

Info

ID:	277860
PubChem CID:	103831360
Reduced:	NOC8H12 (2)
Stoich.:	ABC8D12 (2)
Weight, g/mol:	311.140055
ΔH_f, kcal/mol:	-67.05
Dipole, Da:	3.87
IP(EA), eV:	-9.0(0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[[(2S)-2-aminohexanoyl]amino]-2-chloro-N,N-dimethylbenzamide

Drug info:

PubChemData

Smile

CCCC[C@@H](C(=O)N(CC1=CC(=CC=C1)O)C2CC2)N

DOS

IR

Vibrations