Geometry & MOs

Info

ID:	283112
PubChem CID:	103959035
Reduced:	N3C16H25 (1)
Stoich.:	A3B16C25 (1)
Weight, g/mol:	216.162649
ΔH_f, kcal/mol:	15.15
Dipole, Da:	3.57
IP(EA), eV:	-8.46(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1R)-1-aminopropyl]-N-ethyl-N-prop-2-ynylaniline

Drug info:

PubChemData

Smile

CC[C@H](C1=CC=CC=C1N2CCN3CCCC3C2)N

DOS

IR

Vibrations