Geometry & MOs

Info

ID:	150142
PubChem CID:	53789829
Reduced:	PSN3O8C32H56 (1)
Stoich.:	ABC3D8E32F56 (1)
Weight, g/mol:	188.152478
ΔH_f, kcal/mol:	-466.95
Dipole, Da:	3.68
IP(EA), eV:	-8.7(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-N-ethyl-2-hydroxy-5-methylhexanamide

Drug info:

PubChemData

Smile

CC(C)[C@@H](C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCSC)C(=O)O)NC(=O)COP(=O)(CC=C(C)CCC=C(C)CCC=C(C)C)O

DOS

IR

Vibrations