Geometry & MOs

Info

ID:	262795
PubChem CID:	103318016
Reduced:	SN3C9H13 (1)
Stoich.:	AB3C9D13 (1)
Weight, g/mol:	255.173548
ΔH_f, kcal/mol:	31.95
Dipole, Da:	2.52
IP(EA), eV:	-9.05(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-3-phenyl-7-propan-2-yl-1,5,6,7-tetrahydropyrazolo[1,5-a]pyrimidine

Drug info:

PubChemData

Smile

CC1=C(SC=C1)C2CCN=C(N2)N

DOS

IR

Vibrations