Geometry & MOs

Info

ID:	350578
PubChem CID:	127278613
Reduced:	O2N7C20H21 (1)
Stoich.:	A2B7C20D21 (1)
Weight, g/mol:	378.169191
ΔH_f, kcal/mol:	34.23
Dipole, Da:	3.17
IP(EA), eV:	-8.46(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-morpholin-4-yl-3H-benzimidazol-5-yl)-3,4-dihydro-2H-chromene-4-carboxamide

Drug info:

PubChemData

Smile

CC1=NN(C2=C1C=C(C=N2)C(=O)NC3=CC4=C(C=C3)N=C(N4)N5CCOCC5)C

DOS

IR

Vibrations