Geometry & MOs

Info

ID:	278011
PubChem CID:	103832676
Reduced:	O2N3C10H17 (1)
Stoich.:	A2B3C10D17 (1)
Weight, g/mol:	198.148061
ΔH_f, kcal/mol:	-37.58
Dipole, Da:	2.3
IP(EA), eV:	-9.86(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(1S)-1-amino-3-methylbutyl]-N,N-dimethyl-1,2,4-oxadiazol-3-amine

Drug info:

PubChemData

Smile

CCC[C@H](C1=NC(=NO1)C2CCOC2)N

DOS

IR

Vibrations