Geometry & MOs

Info

ID:	365555
PubChem CID:	127318020
Reduced:	ON6C17H30 (1)
Stoich.:	AB6C17D30 (1)
Weight, g/mol:	293.185175
ΔH_f, kcal/mol:	-36.42
Dipole, Da:	5.12
IP(EA), eV:	-8.88(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(3-methyloxolan-3-yl)methyl]-3-(2-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-6-yl)urea

Drug info:

PubChemData

Smile

CCC1CCCCN1CCNC(=O)NC2CCC3=NC(=NN3C2)C

DOS

IR

Vibrations