Geometry & MOs

Info

ID:	274567
PubChem CID:	103810208
Reduced:	NOC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	243.194677
ΔH_f, kcal/mol:	-117.49
Dipole, Da:	5.19
IP(EA), eV:	-9.4(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3,3-dimethyl-N-[2-(2-methylpropylamino)-2-oxoethyl]butanamide

Drug info:

PubChemData

Smile

C1CCN[C@@H](C1)C(=O)NCC2CCCC2O

DOS

IR

Vibrations