Geometry & MOs

Info

ID:	347893
PubChem CID:	127272955
Reduced:	O3N5C21H29 (1)
Stoich.:	A3B5C21D29 (1)
Weight, g/mol:	340.164774
ΔH_f, kcal/mol:	-101.47
Dipole, Da:	6.18
IP(EA), eV:	-8.38(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2,5-dimethyl-N-(2-morpholin-4-yl-3H-benzimidazol-5-yl)pyrazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(=O)N1CCCCC1C(=O)NC2=CC3=C(C=C2)N=C(N3)N4CCOCC4

DOS

IR

Vibrations