Geometry & MOs

Info

ID:	72229
PubChem CID:	48415948
Reduced:	O3N5C22H29 (1)
Stoich.:	A3B5C22D29 (1)
Weight, g/mol:	392.184841
ΔH_f, kcal/mol:	-109.38
Dipole, Da:	4.48
IP(EA), eV:	-9.17(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(1H-benzimidazol-2-yl)propyl]-N-methyl-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide

Drug info:

PubChemData

Smile

CC1CCCCC12C(=O)N(C(=O)N2)CC(=O)N(C)CCCC3=NC4=CC=CC=C4N3

DOS

IR

Vibrations