Geometry & MOs

Info

ID:	206943
PubChem CID:	80322393
Reduced:	NO2C7H13 (2)
Stoich.:	AB2C7D13 (2)
Weight, g/mol:	319.11469
ΔH_f, kcal/mol:	-183.33
Dipole, Da:	4.81
IP(EA), eV:	-9.39(0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[4-(bromomethyl)oxan-4-yl]methyl]-2-(cyclopropylmethoxy)-N-methylethanamine

Drug info:

PubChemData

Smile

CC(C)C(CNC(=O)N(C)CCOCC1CC1)C(=O)O

DOS

IR

Vibrations