Geometry & MOs

Info

ID:	172357
PubChem CID:	75498127
Reduced:	N3O3C17H27 (1)
Stoich.:	A3B3C17D27 (1)
Weight, g/mol:	220.132411
ΔH_f, kcal/mol:	-129.44
Dipole, Da:	5.87
IP(EA), eV:	-9.42(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylpyrrol-3-yl)methyl]-5-propyl-1,3,4-oxadiazol-2-amine

Drug info:

PubChemData

Smile

CC(C)(C)C1=NN(C(=C1)C(=O)N2CCCC(C2)CCC(=O)O)C

DOS

IR

Vibrations