Geometry & MOs

Info

ID:	74220
PubChem CID:	48421600
Reduced:	O2N5C16H21 (1)
Stoich.:	A2B5C16D21 (1)
Weight, g/mol:	366.191657
ΔH_f, kcal/mol:	-24.51
Dipole, Da:	4.99
IP(EA), eV:	-7.89(-0.64)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-(diethylamino)pyridin-3-yl]-3-[2-methyl-5-(tetrazol-1-yl)phenyl]urea

Drug info:

PubChemData

Smile

CCN(CC)C1=NC=C(C=C1)NC(=O)NC2=C(N=CC=C2)OC

DOS

IR

Vibrations