Geometry & MOs

Info

ID:	360044
PubChem CID:	127300312
Reduced:	S2N3O3C13H25 (1)
Stoich.:	A2B3C3D13E25 (1)
Weight, g/mol:	382.236876
ΔH_f, kcal/mol:	-141.49
Dipole, Da:	4.03
IP(EA), eV:	-8.8(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-tert-butyl-5,6,7,8-tetrahydroimidazo[1,2-a]pyridin-6-yl)-3-(2,3,4,5-tetrahydro-1-benzoxepin-5-yl)urea

Drug info:

PubChemData

Smile

C1CC(C1)CNS(=O)(=O)CCNC(=O)NC2CCSCC2

DOS

IR

Vibrations