Geometry & MOs

Info

ID:	74053
PubChem CID:	48421399
Reduced:	N3O4C18H23 (1)
Stoich.:	A3B4C18D23 (1)
Weight, g/mol:	396.190989
ΔH_f, kcal/mol:	-117.56
Dipole, Da:	2.08
IP(EA), eV:	-8.67(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-hydroxy-3-phenylmethoxypropyl)-1-methyl-3-[2-methyl-5-(tetrazol-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

CN(CC(COCC1=CC=CC=C1)O)C(=O)NC2=C(N=CC=C2)OC

DOS

IR

Vibrations