Geometry & MOs

Info

ID:	412040
PubChem CID:	135084903
Reduced:	N4O5C16H26 (1)
Stoich.:	A4B5C16D26 (1)
Weight, g/mol:	313.225308
ΔH_f, kcal/mol:	-236.02
Dipole, Da:	6.94
IP(EA), eV:	-9.16(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methyl-2-[[(1R,2S,5R)-5-methyl-2-propan-2-ylcyclohexyl]oxycarbonylamino]pentanoic acid

Drug info:

PubChemData

Smile

CNC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@H]2CCCN2

DOS

IR

Vibrations