Geometry & MOs

Info

ID:	347897
PubChem CID:	127272959
Reduced:	O3N5C20H27 (1)
Stoich.:	A3B5C20D27 (1)
Weight, g/mol:	366.180424
ΔH_f, kcal/mol:	-99.76
Dipole, Da:	5.53
IP(EA), eV:	-8.43(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-cyclopropyl-1-methyl-N-(2-morpholin-4-yl-3H-benzimidazol-5-yl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC1=CC2=C(C=C1)N=C(N2)N3CCOCC3)N4CCCC4=O

DOS

IR

Vibrations