Geometry & MOs

Info

ID:	197827
PubChem CID:	79004663
Reduced:	N2O2C11H22 (1)
Stoich.:	A2B2C11D22 (1)
Weight, g/mol:	228.183778
ΔH_f, kcal/mol:	-130.39
Dipole, Da:	2.37
IP(EA), eV:	-9.55(1.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-N-[(4-ethyl-1-hydroxycyclohexyl)methyl]propanamide

Drug info:

PubChemData

Smile

CC1CCCC(C1)(CNC(=O)[C@H](C)N)O

DOS

IR

Vibrations