Geometry & MOs

Info

ID:	290037
PubChem CID:	104400949
Reduced:	ClON4C15H21 (1)
Stoich.:	ABC4D15E21 (1)
Weight, g/mol:	299.184506
ΔH_f, kcal/mol:	-34.44
Dipole, Da:	5.2
IP(EA), eV:	-9.28(-0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3R)-1-[[1-(2-methylpropylamino)-1-oxopropan-2-yl]carbamoyl]piperidine-3-carboxylic acid

Drug info:

PubChemData

Smile

CC1=CC2=C(N=C1)N(C(=N2)CCl)C(C)C(=O)NC(C)(C)C

DOS

IR

Vibrations