Geometry & MOs

Info

ID:	337538
PubChem CID:	127258161
Reduced:	NSO4C15H21 (1)
Stoich.:	ABC4D15E21 (1)
Weight, g/mol:	187.05124
ΔH_f, kcal/mol:	-171.0
Dipole, Da:	3.43
IP(EA), eV:	-9.38(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-amino-6-cyclopropyl-1H-pyrimidin-4-one;hydrochloride

Drug info:

PubChemData

Smile

CC(C)(C)N([C@@H](CS)C(=O)O)C(=O)OCC1=CC=CC=C1

DOS

IR

Vibrations