Geometry & MOs

Info

ID:	358397
PubChem CID:	127295942
Reduced:	O3N4C21H28 (1)
Stoich.:	A3B4C21D28 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-103.37
Dipole, Da:	3.1
IP(EA), eV:	-8.83(-0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[[methyl(oxan-3-ylmethyl)carbamoyl]amino]phenyl]cyclopropanecarboxamide

Drug info:

PubChemData

Smile

CC1=NC2=C(O1)C=C(C=C2)NC(=O)N3CCCN(CC3)C(=O)CC4CCCC4

DOS

IR

Vibrations