Geometry & MOs

Info

ID:	80314
PubChem CID:	49834021
Reduced:	O2N5C15H21 (1)
Stoich.:	A2B5C15D21 (1)
Weight, g/mol:	281.145202
ΔH_f, kcal/mol:	17.41
Dipole, Da:	3.1
IP(EA), eV:	-8.81(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3,4-difluorophenyl)-N,N-dimethyl-3-(5-methyltetrazol-2-yl)propan-1-amine

Drug info:

PubChemData

Smile

CC1=NN(N=N1)C(CCN(C)C)C2COC3=CC=CC=C3O2

DOS

IR

Vibrations