Geometry & MOs

Info

ID:	283445
PubChem CID:	103981541
Reduced:	N2C19H22 (1)
Stoich.:	A2B19C22 (1)
Weight, g/mol:	275.199762
ΔH_f, kcal/mol:	66.99
Dipole, Da:	2.16
IP(EA), eV:	-8.97(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(azepan-4-ylamino)-N-ethyl-3-methylbenzamide

Drug info:

PubChemData

Smile

C1CNCC2=CC=CC=C2C1NCC3CC4=CC=CC=C34

DOS

IR

Vibrations