Geometry & MOs

Info

ID:	74145
PubChem CID:	48421514
Reduced:	SO4N5C17H25 (1)
Stoich.:	AB4C5D17E25 (1)
Weight, g/mol:	392.217203
ΔH_f, kcal/mol:	-94.2
Dipole, Da:	4.36
IP(EA), eV:	-9.2(-1.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-hydroxy-3-(2-propan-2-yloxyethoxy)propyl]-1-methyl-3-[2-methyl-5-(tetrazol-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

CC(C)OCCOCC(CN(C)C(=O)NC1=NN=C(S1)C2=CC=CC=N2)O

DOS

IR

Vibrations