Geometry & MOs

Info

ID:	122041
PubChem CID:	50790835
Reduced:	O2N5C27H29 (1)
Stoich.:	A2B5C27D29 (1)
Weight, g/mol:	368.163711
ΔH_f, kcal/mol:	22.17
Dipole, Da:	3.25
IP(EA), eV:	-8.54(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,3-dihydroindol-1-yl-(2,7-dimethyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)methanone

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C2=C3N=CC(=C(N3N=C2C)C)C(=O)N4CCN(CC4)C5=CC(=CC=C5)OC

DOS

IR

Vibrations