Geometry & MOs

Info

ID:	76804
PubChem CID:	48425407
Reduced:	O2N4C17H20 (1)
Stoich.:	A2B4C17D20 (1)
Weight, g/mol:	358.211724
ΔH_f, kcal/mol:	-23.65
Dipole, Da:	3.15
IP(EA), eV:	-8.94(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-methyl-2-(5-phenyltetrazol-2-yl)butanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)C1=CN(C2=CC=CC=C21)CC#N

DOS

IR

Vibrations