Geometry & MOs

Info

ID:	251994
PubChem CID:	103108354
Reduced:	N2O3C13H26 (1)
Stoich.:	A2B3C13D26 (1)
Weight, g/mol:	225.184112
ΔH_f, kcal/mol:	-172.87
Dipole, Da:	4.44
IP(EA), eV:	-9.02(0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-N-methyl-2-(3,4,5,6-tetrahydro-2H-azepin-7-ylamino)propanamide

Drug info:

PubChemData

Smile

CCN(C)C(=O)C(C)NC(C)C(=O)OC(C)(C)C

DOS

IR

Vibrations