Geometry & MOs

Info

ID:	343055
PubChem CID:	127266228
Reduced:	N2O2H7C8 (2)
Stoich.:	A2B2C7D8 (2)
Weight, g/mol:	329.185175
ΔH_f, kcal/mol:	-19.61
Dipole, Da:	4.63
IP(EA), eV:	-9.38(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-tert-butyl-N-(2-phenyloxan-4-yl)tetrazole-5-carboxamide

Drug info:

PubChemData

Smile

C1CN(CC1OC2=CC=CC=N2)C(=O)C3=C(OC=N3)C4=NOC=C4

DOS

IR

Vibrations