Geometry & MOs

Info

ID:	179118
PubChem CID:	76436447
Reduced:	SN2O5C17H24 (1)
Stoich.:	AB2C5D17E24 (1)
Weight, g/mol:	272.138559
ΔH_f, kcal/mol:	-185.77
Dipole, Da:	3.26
IP(EA), eV:	-9.06(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-aminocyclobutyl)-4-(tetrazol-1-ylmethyl)benzamide

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)C(=O)O)S(=O)(=O)NC2CCC2NC3CCCC3

DOS

IR

Vibrations