Geometry & MOs

Info

ID:	33518
PubChem CID:	7886802
Reduced:	NO5H21C22 (1)
Stoich.:	AB5C21D22 (1)
Weight, g/mol:	350.087118
ΔH_f, kcal/mol:	-150.96
Dipole, Da:	7.61
IP(EA), eV:	-9.25(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2R)-N-carbamoyl-3-methyl-2-(7-thia-9,11-diazatricyclo[6.4.0.02,6]dodeca-1(8),2(6),9,11-tetraen-12-ylsulfanyl)butanamide

Drug info:

PubChemData

Smile

CC(=O)NCCCC1=CC=C(C=C1)C(=O)COC2=CC3=C(C=C2)C=CC(=O)O3

DOS

IR

Vibrations