Geometry & MOs

Info

ID:	216820
PubChem CID:	85086828
Reduced:	SN3O4C13H13 (1)
Stoich.:	AB3C4D13E13 (1)
Weight, g/mol:	305.126323
ΔH_f, kcal/mol:	-98.58
Dipole, Da:	2.18
IP(EA), eV:	-9.14(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(10-phenyl-3,6,9,11-tetraoxatricyclo[5.4.0.02,4]undecan-5-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC1(OC(=O)C(=C2NN(NS2)C3=CC=CC=C3)C(=O)O1)C

DOS

IR

Vibrations