Geometry & MOs

Info

ID:	305753
PubChem CID:	124968022
Reduced:	O3N5C27H31 (1)
Stoich.:	A3B5C27D31 (1)
Weight, g/mol:	355.110296
ΔH_f, kcal/mol:	-70.8
Dipole, Da:	10.01
IP(EA), eV:	-8.25(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-methyl-7-[(2R)-1-(thiophene-2-carbonyl)pyrrolidin-2-yl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)NC(=O)CN2CCN(C[C@H](C2)CC3=CC=CC4=C3N=CC=C4)C(=O)C

DOS

IR

Vibrations