Geometry & MOs

Info

ID:	275822
PubChem CID:	103818138
Reduced:	NOF3H14C15 (1)
Stoich.:	ABC3D14E15 (1)
Weight, g/mol:	304.164774
ΔH_f, kcal/mol:	-153.37
Dipole, Da:	1.56
IP(EA), eV:	-8.5(-0.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[4-(tetrazol-1-yl)anilino]ethyl]carbamate

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)F)CNC2=CC=CC=C2OC(F)F

DOS

IR

Vibrations