Geometry & MOs

Info

ID:	130581
PubChem CID:	51091362
Reduced:	N2O3C20H22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	327.151767
ΔH_f, kcal/mol:	-77.77
Dipole, Da:	2.77
IP(EA), eV:	-9.4(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,2-dimethyl-N-[(1-phenyltetrazol-5-yl)methyl]-1-thiophen-2-ylpropan-1-amine

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC(=C1)CN2CCNC(=O)CC2C3=CC=CC=C3

DOS

IR

Vibrations