Geometry & MOs

Info

ID:	273755
PubChem CID:	103799534
Reduced:	O3N4C14H18 (1)
Stoich.:	A3B4C14D18 (1)
Weight, g/mol:	297.089561
ΔH_f, kcal/mol:	-45.69
Dipole, Da:	5.56
IP(EA), eV:	-9.64(-1.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-hydroxy-1-methoxybutan-2-yl)-3-(tetrazol-1-yl)thiophene-2-carboxamide

Drug info:

PubChemData

Smile

COCC(CCO)NC(=O)C1=NN(N=C1)C2=CC=CC=C2

DOS

IR

Vibrations