Geometry & MOs

Info

ID:	249006
PubChem CID:	103086180
Reduced:	F2N5C12H15 (1)
Stoich.:	A2B5C12D15 (1)
Weight, g/mol:	281.145202
ΔH_f, kcal/mol:	0.69
Dipole, Da:	7.53
IP(EA), eV:	-9.28(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-[1-[(2,5-difluorophenyl)methyl]tetrazol-5-yl]ethyl]propan-1-amine

Drug info:

PubChemData

Smile

CCNC(C)C1=NN=NN1CC2=C(C=CC(=C2)F)F

DOS

IR

Vibrations