Geometry & MOs

Info

ID:	346901
PubChem CID:	127271405
Reduced:	O2N3C12H17 (1)
Stoich.:	A2B3C12D17 (1)
Weight, g/mol:	366.183795
ΔH_f, kcal/mol:	-40.37
Dipole, Da:	1.81
IP(EA), eV:	-8.94(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-cyclopropyltetrazol-5-yl)sulfanyl-N-[1-(2-methylpiperidin-1-yl)-1-oxopropan-2-yl]propanamide

Drug info:

PubChemData

Smile

CC1=C(N=CO1)C(=O)NC2CCN(C2)C3CC3

DOS

IR

Vibrations