Geometry & MOs

Info

ID:	277520
PubChem CID:	103829176
Reduced:	N2O3C10H18 (1)
Stoich.:	A2B3C10D18 (1)
Weight, g/mol:	325.038482
ΔH_f, kcal/mol:	-151.96
Dipole, Da:	5.62
IP(EA), eV:	-9.73(0.46)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-chloro-N-(3-chloro-4-hydroxyphenyl)-2-propan-2-ylpyrimidine-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)N(CCO)C(=O)[C@H]1CCC(=O)N1

DOS

IR

Vibrations