Geometry & MOs

Info

ID:	423652
PubChem CID:	135119946
Reduced:	N3O3C18H23 (1)
Stoich.:	A3B3C18D23 (1)
Weight, g/mol:	370.131091
ΔH_f, kcal/mol:	-64.92
Dipole, Da:	8.02
IP(EA), eV:	-8.3(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopropyl-N-[(3R,4S)-4-(dimethylsulfamoylmethyl)oxolan-3-yl]-6-oxo-1H-pyrimidine-5-carboxamide

Drug info:

PubChemData

Smile

COC1=CNC(=CC1=O)CN2CCC(CC2)OCC3=CC=CC=N3

DOS

IR

Vibrations